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Substance Name: Morpholine, 4-((3,4-dihydroxy-5-methoxyphenyl)thioxomethyl)-
RN: 70733-95-8
InChIKey: JQMKUHHFZBNNPK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H15-N-O4-S

Molecular Weight

  • 269.3195
 
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Names and Synonyms

Synonyms

  • 4-((3,4-Dihydroxy-5-methoxyphenyl)thioxomethyl)morpholine
  • BRN 0534113

Systematic Name

  • Morpholine, 4-((3,4-dihydroxy-5-methoxyphenyl)thioxomethyl)-

Registry Numbers

CAS Registry Number

  • 70733-95-8

System Generated Number

  • 0070733958

Structure Descriptors

InChI

1S/C12H15NO4S/c1-16-10-7-8(6-9(14)11(10)15)12(18)13-2-4-17-5-3-13/h6-7,14-15H,2-5H2,1H3

InChIKey

JQMKUHHFZBNNPK-UHFFFAOYSA-N

Smiles

COc1cc(cc(c1O)O)C(=S)N2CCOCC2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1gm/kg (1000mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 14, Pg. 27, 1979.